Information card for entry 4121712

Structure parameters

• Formula: C18 H24 As P
• Calculated formula: C18 H24 As P
• SMILES: [AsH2]c1ccc2c3c(ccc(P(C(C)C)C(C)C)c13)CC2
• Title of publication: Geometrically enforced donor-facilitated dehydrocoupling leading to an isolable arsanylidine-phosphorane.
• Authors of publication: Chalmers, Brian A.; Bühl, Michael; Athukorala Arachchige, Kasun S.; Slawin, Alexandra M. Z.; Kilian, Petr
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 17
• Pages of publication: 6247 - 6250
• a: 7.519 ± 0.002 Å
• b: 8.53 ± 0.002 Å
• c: 14.504 ± 0.004 Å
• α: 79.9 ± 0.03°
• β: 81.97 ± 0.03°
• γ: 65.587 ± 0.019°
• Cell volume: 831.6 ± 0.4 ų
• Cell temperature: 93 K
• Ambient diffraction temperature: 93 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0639
• Weighted residual factors for all reflections included in the refinement: 0.1721
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No